For research use only. Not for therapeutic Use.
4-tert-Butyl-1,2-bis(chloromethyl)benzene (Cat No.:C000927) is an organic compound. It is a white to off-white solid and belongs to the family of chlorinated benzene derivatives. This compound is used as a building block and reagent in organic synthesis, particularly in the production of pharmaceuticals, agrochemicals, and specialty chemicals. It contains both a tert-butyl and a bis(chloromethyl) functional group, making it valuable in various chemical reactions to form different derivatives.
| CAS Number | 141788-33-2 |
| Synonyms | 1,2-bis(Chloromethyl)-4-(1,1-dimethylethyl)-benzene; |
| Molecular Formula | C₁₂H₁₆Cl₂ |
| Purity | ≥95% |
| Solubility | Chloroform (Slightly), Hexane (Slightly) |
| Appearance | Colourless Oil |
| Storage | 4°C, Inert atmosphere |
| IUPAC Name | 4-tert-butyl-1,2-bis(chloromethyl)benzene |
| InChI | InChI=1S/C12H16Cl2/c1-12(2,3)11-5-4-9(7-13)10(6-11)8-14/h4-6H,7-8H2,1-3H3 |
| InChIKey | ZDRSEVCJTGMTRQ-UHFFFAOYSA-N |
| SMILES | CC(C)(C)C1=CC(=C(C=C1)CCl)CCl |
| Reference | Komeyama, K., et al.: Angew. Chem. Int. Ed., 53, 11325 (2014); |
| Chemistry Calculators | Dilution Calculator In vivo Formulation Calculator Molarity Calculator Molecular Weight Calculator Reconstitution Calculator |